| Optimization of Thermochemical Stability of La-based/Zr-based Dual-Phase Composites for Oxygen Transport Membranes via Computational Thermodynamics H Sabarou, R Wang, Z Lu, Y Zhong Materials Chemistry and Physics, 129482, 2024 | | 2024 |
| Chemistry Informed Machine Learning-Based Heat Capacity Prediction of Solid Mixed Oxides J Barra, R Chahal, S Audesse, J Zhang, Y Zhong, J Kabel, S Lam The Journal of Physical Chemistry Letters 15, 4721-4728, 2024 | | 2024 |
| X-ray and molecular dynamics study of the temperature-dependent structure of molten NaF-ZrF4 A Wadehra, R Chahal, S Banerjee, A Levy, Y Zhang, H Yan, D Olds, ... arXiv preprint arXiv:2403.06049, 2024 | | 2024 |
| X-ray and molecular dynamics study of the temperature-dependent structure of FLiNaK J Guo, Y Zhang, K Ludwig, H Yan, A Levy, A Wadehra, MC Gao, ... Nuclear Materials and Energy 37, 101530, 2023 | 2 | 2023 |
| Ab initio investigations on the electronic properties and stability of Cu-substituted lead apatite (LK-99) family with different doping concentrations (x= 0, 1, 2) S Yang, G Liu, Y Zhong Materials Today Communications 37, 107379, 2023 | 9 | 2023 |
| Ab Initio Modeling on The Thermodynamic and Temperature-Dependent Elastic Properties of Subsystems of The FCC FeNiCoCr Medium Entropy Alloys (MEAs) S Yang, Y Wang, Z Liu, B Mishra, Y Zhong Acta Materialia 260, 119341, 2023 | 3 | 2023 |
| A systematic ab initio study of vacancy formation energy, diffusivity, and ionic conductivity of Ln2NiO4+ δ (Ln= La, Nd, Pr) S Yang, G Liu, YL Lee, JM Bassat, J Gamon, A Villesuzanne, J Pietras, ... Journal of Power Sources 576, 233200, 2023 | 8 | 2023 |
| MD Simulation and Transport Property Analysis of Silicon in High-Temperature Molten Fluoride Salts Electrolyte Y Zhang, R Chahal, M Gao, K Ludwig, U Pal, AC Powell IV, S Lam, ... Electrochemical Society Meeting Abstracts 243, 1541-1541, 2023 | | 2023 |
| Zero-Direct-Carbon-Emission Production of Si Epitaxy Enabled by Solid Oxide Membrane (SOM) Electrolysis H Yan, H Flagg, U Pal, AC Powell IV, Y Zhong Electrochemical Society Meeting Abstracts 243, 1540-1540, 2023 | | 2023 |
| Ab initio studies on structural and thermodynamic properties of magnetic Fe S Yang, Y Wang, ZK Liu, Y Zhong Computational Materials Science 227, 112299, 2023 | 5 | 2023 |
| Summary report of CALPHAD GLOBAL, 2021 Y Zhong, R Otis, S McCormack, W Xiong, ZK Liu Calphad 81, 102527, 2023 | 2 | 2023 |
| Computational and Experimental Study on the Combined Sulfur and Chromium Poisoning Mechanism of LSM, LSCF and LNO Cathodes R Wang, LR Parent, S Gopalan, Y Zhong ECS Transactions 111 (6), 2005, 2023 | 1 | 2023 |
| Sulfur poisoning mechanism of LSCF cathode material in the presence of SO2: a computational and experimental study R Wang, LR Parent, Y Zhong Journal of Materials Informatics 3 (1), 2023 | 1 | 2023 |
| Modeling assisted synthesis of Zr-doped Li3-xIn1-xZrxCl6 with ultrahigh ionic conductivity for lithium-ion batteries J Fu, S Yang, J Hou, L Azhari, Z Yao, X Ma, Y Liu, P Vanaphuti, Z Meng, ... Journal of Power Sources 556, 232465, 2023 | 8 | 2023 |
| Experimental and computational investigations on the SO2 poisoning of (La0. 8Sr0. 2) 0.95 MnO3 cathode materials R Wang, LR Parent, S Gopalan, Y Zhong Advanced Powder Materials 2 (1), 100062, 2023 | 12 | 2023 |
| Energy and mechanical properties predictions in Fe-Ni binary system by ab initio calculations V Drozd, M Asadikiya, S Yang, Y Zhong Materials Today Communications 33, 104118, 2022 | 4 | 2022 |
| Identification of the Eutectic Points in the Multicomponent Systems with the High-Throughput CALPHAD Approach J Zhang, R Wang, Y Zhong Journal of Phase Equilibria and Diffusion 43 (6), 844-857, 2022 | 4 | 2022 |
| Weight Change Mechanism of Lanthanum Strontium Manganite (LSM) During Thermal Cycles Y Zhong, R Wang, V Drozd, D Lowry, H Sabarou, YS Autul, S Pankaj JOM 74 (12), 4533-4543, 2022 | | 2022 |
| Revisit the VEC criterion in high entropy alloys (HEAs) with high-throughput ab initio calculations: a case study with Al-Co-Cr-Fe-Ni system S Yang, G Liu, Y Zhong Journal of Alloys and Compounds 916, 165477, 2022 | 18 | 2022 |
| Zr diffusion in BCC refractory high entropy alloys: A case of ‘non-sluggish’diffusion behavior J Zhang, C Gadelmeier, S Sen, R Wang, X Zhang, Y Zhong, U Glatzel, ... Acta Materialia 233, 117970, 2022 | 44 | 2022 |
Zi-Kui Liu, Dorothy Pate Enright Profes...The Pennsylvania State University在 psu.edu 的电子邮件经过验证
